2,3-dimethyl-1,3-benzothiazol-3-ium 1,1-dioxide

Systemtic Name: 2,3-dimethyl-1,3-benzothiazol-3-ium 1,1-dioxide Openeye Name: 2,3-dimethyl-1,3-benzothiazol-3-ium 1,1-dioxide CAS Name: 2,3-dimethyl-1,3-benzothiazol-3-ium 1,1-dioxide IUPAC Name: 2,3-dimethyl-1,3-benzothiazol-3-ium 1,1-dioxide Traditional Name: 2,3-dimethyl-1,3-benzothiazol-3-ium 1,1-dioxide Formula: C9H10NO2S+ MolecularWeight: 196.2462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=CC=CC=C2S1(=O)=O)C

Isomeric SMILES

CC1=[N+](C2=CC=CC=C2S1(=O)=O)C

InChI

InChI=1S/C9H10NO2S/c1-7-10(2)8-5-3-4-6-9(8)13(7,11)12/h3-6H,1-2H3/q+1